CID 38952

41727-53-1

Structural Information

Molecular Formula
C10H9Cl2NO2
SMILES
C=CCOC1=C(C=C(C=C1Cl)C(=O)N)Cl
InChI
InChI=1S/C10H9Cl2NO2/c1-2-3-15-9-7(11)4-6(10(13)14)5-8(9)12/h2,4-5H,1,3H2,(H2,13,14)
InChIKey
QAFXHUDHHDQWJD-UHFFFAOYSA-N
Compound name
3,5-dichloro-4-prop-2-enoxybenzamide
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

245.00104 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 246.00832 148.2
[M+Na]+ 267.99026 161.6
[M+NH4]+ 263.03486 156.1
[M+K]+ 283.96420 154.7
[M-H]- 243.99376 149.9
[M+Na-2H]- 265.97571 153.9
[M]+ 245.00049 151.0
[M]- 245.00159 151.0
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

No patent data available for this compound.